Geometry & MOs

Info

ID:	178872
PubChem CID:	76394513
Reduced:	NO2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	415.16444
ΔH_f, kcal/mol:	-59.48
Dipole, Da:	4.04
IP(EA), eV:	-9.82(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyanophenyl)-1,3-dioxo-2-(2-phenylcyclopropyl)-5,6,8,8a-tetrahydroimidazo[1,5-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C(=O)C=CC1=CC=CC=C1[N+](=O)[O-]

DOS

IR

Vibrations