Geometry & MOs

Info

ID:	398624
PubChem CID:	135034367
Reduced:	NOS2H11C16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	330.078662
ΔH_f, kcal/mol:	45.51
Dipole, Da:	4.11
IP(EA), eV:	-8.9(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[6-(phenylsulfonimidoyl)-1H-benzimidazol-2-yl]carbamate

Drug info:

PubChemData

Smile

C1C(C(=O)C2=CC=CC=C21)SC3=NC4=CC=CC=C4S3

DOS

IR

Vibrations