Geometry & MOs

Info

ID:	249733
PubChem CID:	103091687
Reduced:	FNC12H16 (1)
Stoich.:	ABC12D16 (1)
Weight, g/mol:	255.102607
ΔH_f, kcal/mol:	-36.43
Dipole, Da:	3.88
IP(EA), eV:	-9.09(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-(2-chloro-3,4-dimethoxyphenyl)-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)/C=C(\C)/C(C)N)F

DOS

IR

Vibrations