Geometry & MOs

Info

ID:	72636
PubChem CID:	48416384
Reduced:	N5O6C19H23 (1)
Stoich.:	A5B6C19D23 (1)
Weight, g/mol:	413.206304
ΔH_f, kcal/mol:	-149.82
Dipole, Da:	6.99
IP(EA), eV:	-9.61(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-oxo-2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]ethyl]-4-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CCCN2C3=C(C=C(C=C3)[N+](=O)[O-])OC2=O)N4CCNC4=O

DOS

IR

Vibrations