Geometry & MOs

Info

ID:	309179
PubChem CID:	126539592
Reduced:	ON2H28C29 (1)
Stoich.:	AB2C28D29 (1)
Weight, g/mol:	280.287849
ΔH_f, kcal/mol:	32.89
Dipole, Da:	5.53
IP(EA), eV:	-8.4(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(1-aminopropyl)cyclohexyl]-N-propylcyclohexan-1-amine

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)NC2=CC=C(C=C2)C(=O)C3=CC=C(C=C3)NC4=C(C=CC=C4C)C

DOS

IR

Vibrations