Geometry & MOs

Info

ID:	262441
PubChem CID:	103293043
Reduced:	BrClOSN3H11C14 (1)
Stoich.:	ABCDE3F11G14 (1)
Weight, g/mol:	301.09819
ΔH_f, kcal/mol:	35.81
Dipole, Da:	1.19
IP(EA), eV:	-8.51(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-chloro-6-methoxyphenyl)methyl]-7-methylbenzimidazol-2-amine

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)Cl)CN2C3=C(C=C(C=N3)Br)NC2=S

DOS

IR

Vibrations