Geometry & MOs

Info

ID:	290007
PubChem CID:	104397305
Reduced:	FNC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	332.06549
ΔH_f, kcal/mol:	-97.72
Dipole, Da:	3.65
IP(EA), eV:	-9.1(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[(4-bromo-2-chlorophenyl)methyl]-1-N-(2-methylpropyl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)CNCC(C)NCC1=CC(=CC(=C1)F)F

DOS

IR

Vibrations