Geometry & MOs

Info

ID:	249700
PubChem CID:	103091430
Reduced:	N3C13H15 (1)
Stoich.:	A3B13C15 (1)
Weight, g/mol:	241.086957
ΔH_f, kcal/mol:	66.79
Dipole, Da:	2.9
IP(EA), eV:	-9.06(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(3-chloro-4,5-dimethoxyphenyl)but-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C=C/C1=CC=C(C=C1)N2C=CN=C2)N

DOS

IR

Vibrations