Geometry & MOs

Info

ID:	267243
PubChem CID:	103581498
Reduced:	BrClNOF2H13C15 (1)
Stoich.:	ABCDE2F13G15 (1)
Weight, g/mol:	303.9978
ΔH_f, kcal/mol:	-102.49
Dipole, Da:	3.79
IP(EA), eV:	-9.45(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromo-3-chlorophenyl)methylamino]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CNCC2=CC(=C(C=C2)Br)Cl)OC(F)F

DOS

IR

Vibrations