Geometry & MOs

Info

ID:	200721
PubChem CID:	79431502
Reduced:	ClBr2N2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	387.9052
ΔH_f, kcal/mol:	31.57
Dipole, Da:	1.35
IP(EA), eV:	-9.28(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-[1-bromo-3-(2-chlorophenyl)propan-2-yl]benzene

Drug info:

PubChemData

Smile

CCC1=NN(C(=C1Br)CC(CCl)C2=CC(=CC=C2)Br)C

DOS

IR

Vibrations