Geometry & MOs

Info

ID:	255235
PubChem CID:	103130824
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	269.189198
ΔH_f, kcal/mol:	54.15
Dipole, Da:	3.04
IP(EA), eV:	-8.91(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-methylpyrazol-3-yl)-(1-phenylcyclohexyl)methanamine

Drug info:

PubChemData

Smile

CN1C=CC(=N1)C(C2(CCCC2)C3=CC=CC=C3)N

DOS

IR

Vibrations