Geometry & MOs

Info

ID:	197863
PubChem CID:	79007332
Reduced:	NO2C16H21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	231.1987
ΔH_f, kcal/mol:	-45.83
Dipole, Da:	2.74
IP(EA), eV:	-8.7(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-phenylbutan-2-yl)cyclohexanamine

Drug info:

PubChemData

Smile

C1CCC(C1)COC2=CC=CC\3=C2CCC/C3=N/O

DOS

IR

Vibrations