Geometry & MOs

Info

ID:	209585
PubChem CID:	80690848
Reduced:	BrNOC9H20 (1)
Stoich.:	ABCD9E20 (1)
Weight, g/mol:	380.9762
ΔH_f, kcal/mol:	-70.03
Dipole, Da:	2.02
IP(EA), eV:	-7.85(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(3-bromo-4-methoxyphenyl)methyl]-3-methoxy-N-methylpropan-1-amine

Drug info:

PubChemData

Smile

CCC(C)N(C)CC(COC)Br

DOS

IR

Vibrations