Geometry & MOs

Info

ID:	250027
PubChem CID:	103093689
Reduced:	NC14H27 (1)
Stoich.:	AB14C27 (1)
Weight, g/mol:	237.128427
ΔH_f, kcal/mol:	-36.3
Dipole, Da:	1.21
IP(EA), eV:	-8.75(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(3-chlorophenyl)-3-methyl-N-propylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCCNC(C)C(=CC1CCCCC1)C

DOS

IR

Vibrations