Geometry & MOs

Info

ID:	47970
PubChem CID:	10536083
Reduced:	NC14H19 (1)
Stoich.:	AB14C19 (1)
Weight, g/mol:	201.15175
ΔH_f, kcal/mol:	66.14
Dipole, Da:	1.78
IP(EA), eV:	-9.68(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-benzyl-N-prop-2-enylbut-2-en-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)C12CC(C1)(C2)C3=CC=CC=N3

DOS

IR

Vibrations