Geometry & MOs

Info

ID:	69203
PubChem CID:	46530447
Reduced:	O4N5C16H17 (1)
Stoich.:	A4B5C16D17 (1)
Weight, g/mol:	447.190654
ΔH_f, kcal/mol:	-49.65
Dipole, Da:	5.13
IP(EA), eV:	-8.49(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[2-(2',5'-dioxospiro[1,2-dihydroindene-3,4'-imidazolidine]-1'-yl)acetyl]amino]-4-pyrrolidin-1-ylbenzamide

Drug info:

PubChemData

Smile

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)NC(=O)NC

DOS

IR

Vibrations