Geometry & MOs

Info

ID:	293817
PubChem CID:	117402986
Reduced:	NOC17H25 (1)
Stoich.:	ABC17D25 (1)
Weight, g/mol:	259.23
ΔH_f, kcal/mol:	-40.99
Dipole, Da:	1.7
IP(EA), eV:	-9.3(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(4,4-dimethylcyclohexyl)phenyl]butan-1-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)(CN)C2=CC=CC=C2C3CCOC3

DOS

IR

Vibrations