Geometry & MOs

Info

ID:	302520
PubChem CID:	124365640
Reduced:	N3O3C22H29 (1)
Stoich.:	A3B3C22D29 (1)
Weight, g/mol:	397.236542
ΔH_f, kcal/mol:	-124.91
Dipole, Da:	4.03
IP(EA), eV:	-9.18(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(4R)-2,5-dioxo-1-propylimidazolidin-4-yl]-N-[(1S,6R,7S,8R)-8-phenyl-7-bicyclo[4.2.0]octanyl]propanamide

Drug info:

PubChemData

Smile

CCCN1C(=O)[C@H](NC1=O)CC(=O)N[C@H]2[C@@H]3CCCC[C@@H]3[C@@H]2C4=CC=CC=C4

DOS

IR

Vibrations