Geometry & MOs

Info

ID:	249739
PubChem CID:	103091711
Reduced:	N3C14H17 (1)
Stoich.:	A3B14C17 (1)
Weight, g/mol:	269.04153
ΔH_f, kcal/mol:	58.55
Dipole, Da:	3.93
IP(EA), eV:	-9.04(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-(3-bromo-4-methoxyphenyl)-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations