Geometry & MOs

Info

ID:	345059
PubChem CID:	127268819
Reduced:	NSO2C7H14 (2)
Stoich.:	ABC2D7E14 (2)
Weight, g/mol:	399.125277
ΔH_f, kcal/mol:	-196.64
Dipole, Da:	8.61
IP(EA), eV:	-9.06(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(2,3-dihydro-1,4-benzodioxin-5-ylsulfonyl)pyrrolidin-2-yl]-1-methylbenzimidazole

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(C)CNS(=O)(=O)C2CCS(=O)(=O)CC2

DOS

IR

Vibrations