Geometry & MOs

Info

ID:	249791
PubChem CID:	103092131
Reduced:	NOC13H19 (1)
Stoich.:	ABC13D19 (1)
Weight, g/mol:	181.18305
ΔH_f, kcal/mol:	-15.52
Dipole, Da:	1.18
IP(EA), eV:	-8.48(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-methyl-4-(4-methylcyclohexyl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1/C=C/C(C)NC

DOS

IR

Vibrations