Geometry & MOs

Info

ID:	293498
PubChem CID:	117391870
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	255.173548
ΔH_f, kcal/mol:	48.77
Dipole, Da:	2.17
IP(EA), eV:	-8.82(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-cycloheptylphenyl)-1H-pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2=CC=CC(=C2)CC3CCNCC3

DOS

IR

Vibrations