Geometry & MOs

Info

ID:	188303
PubChem CID:	77696113
Reduced:	ON4C17H18 (1)
Stoich.:	AB4C17D18 (1)
Weight, g/mol:	436.189926
ΔH_f, kcal/mol:	73.57
Dipole, Da:	6.78
IP(EA), eV:	-8.35(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-phenylmethoxyphenyl)-1,2,3,3a,4,5-hexahydropyrazolo[3,4-a]carbazole-7-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC(=O)NC1=CC2=C3CC4C=NNC4=C3N=C2C=C1

DOS

IR

Vibrations