Geometry & MOs

Info

ID:	249845
PubChem CID:	103092479
Reduced:	NC4H7 (3)
Stoich.:	AB4C7 (3)
Weight, g/mol:	287.00764
ΔH_f, kcal/mol:	18.56
Dipole, Da:	6.48
IP(EA), eV:	-8.74(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(2-bromo-5-chlorophenyl)-N-ethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CCNC(C)/C=C/C1=CN=CN1C(C)C

DOS

IR

Vibrations