Geometry & MOs

Info

ID:

448677

PubChem CID:

135292760

Reduced:

N4O7C27H36 (1)

Stoich.:

A4B7C27D36 (1)

Weight, g/mol:

592.238058

ΔHf, kcal/mol:

-240.81

Dipole, Da:

7.05

IP(EA), eV:

 -9.04(-0.52)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[2-[[4-[dihydroxy(morpholin-4-yl)methyl]phenyl]methylamino]-6-methylphenyl]methyl-formylamino]-2,3,3,4,4-pentahydroxy-N-methyl-5-oxopentanamide

Drug info:

PubChemData

Smile

CNC(=O)CCC(C=O)(N(C)CC1=C(C=CC=C1NC(C2=CC=C(C=C2)CN3CCOCC3)(O)O)C=O)O

DOS

IR

Vibrations