Geometry & MOs

Info

ID:	174778
PubChem CID:	75813174
Reduced:	ClNOC15H22 (1)
Stoich.:	ABCD15E22 (1)
Weight, g/mol:	406.182733
ΔH_f, kcal/mol:	-72.77
Dipole, Da:	2.9
IP(EA), eV:	-9.43(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)-2-thiophen-2-ylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCCC(C)C(=O)NC(C)CC1=CC(=CC=C1)Cl

DOS

IR

Vibrations