Geometry & MOs

Info

ID:	249749
PubChem CID:	103091838
Reduced:	NCl2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	269.118257
ΔH_f, kcal/mol:	0.75
Dipole, Da:	2.58
IP(EA), eV:	-9.39(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-(3-chloro-4-ethoxy-5-methoxyphenyl)-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C(=C/C1=C(C=CC=C1Cl)Cl)/C)N

DOS

IR

Vibrations