Geometry & MOs

Info

ID:	188211
PubChem CID:	77682177
Reduced:	ON2C20H30 (1)
Stoich.:	AB2C20D30 (1)
Weight, g/mol:	729.31962
ΔH_f, kcal/mol:	-56.19
Dipole, Da:	3.19
IP(EA), eV:	-8.72(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2,5-dioxo-1-(quinolin-2-ylmethyl)imidazolidin-4-yl]-N-[3-hydroxy-4-[(4-methoxyphenyl)sulfonyl-(2-methylpropyl)amino]-1-phenylbutan-2-yl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1)C2CCN(CC2)CC3CCCNC3=O

DOS

IR

Vibrations