Geometry & MOs

Info

ID:	373676
PubChem CID:	131318619
Reduced:	ClNSO2H10C11 (1)
Stoich.:	ABCD2E10F11 (1)
Weight, g/mol:	322.94793
ΔH_f, kcal/mol:	-54.61
Dipole, Da:	3.98
IP(EA), eV:	-8.41(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(2,6-dichlorophenyl)methyl]-N-methylpropanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(C=C1)C(=C(S2)Cl)N

DOS

IR

Vibrations