Geometry & MOs

Info

ID:

186894

PubChem CID:

77501564

Reduced:

N4O7C35H52 (1)

Stoich.:

A4B7C35D52 (1)

Weight, g/mol:

760.398205

ΔHf, kcal/mol:

-297.23

Dipole, Da:

2.19

IP(EA), eV:

 -8.96(-0.12)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-ethyl-N-[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-3-methyl-2-[3-[(1-methylbenzimidazol-2-yl)methyl]-2-oxoimidazolidin-1-yl]pentanamide

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1)C(=O)NC2CN(CC2CN(C(C)C)C(=O)C3=CC(=C(C=C3)OC)OCCCOC)C(=O)OC(C)(C)C

DOS

IR

Vibrations