Geometry & MOs

Info

ID:	249946
PubChem CID:	103093032
Reduced:	BrNSC10H14 (1)
Stoich.:	ABCD10E14 (1)
Weight, g/mol:	243.058155
ΔH_f, kcal/mol:	32.53
Dipole, Da:	3.78
IP(EA), eV:	-9.14(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(3,4-dichlorophenyl)-N,3-dimethylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC(/C(=C/C1=CC=C(S1)Br)/C)NC

DOS

IR

Vibrations