Geometry & MOs

Info

ID:	156436
PubChem CID:	56370604
Reduced:	NOC11H16 (2)
Stoich.:	ABC11D16 (2)
Weight, g/mol:	352.226312
ΔH_f, kcal/mol:	-94.62
Dipole, Da:	1.64
IP(EA), eV:	-8.65(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cycloheptylpyrrolidin-3-yl)-3-phenyl-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)CCC(=O)NC2CCN(C2)C3CCCCCC3

DOS

IR

Vibrations