Geometry & MOs

Info

ID:	252570
PubChem CID:	103112374
Reduced:	BrClON4C14H18 (1)
Stoich.:	ABCD4E14F18 (1)
Weight, g/mol:	307.14514
ΔH_f, kcal/mol:	-7.78
Dipole, Da:	6.1
IP(EA), eV:	-9.31(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2-chloroethyl)-6-methylbenzimidazol-1-yl]-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)N1C2=C(C=C(C=N2)Br)N=C1C(C)Cl

DOS

IR

Vibrations