Geometry & MOs

Info

ID:	423320
PubChem CID:	135119307
Reduced:	NO4C23H27 (1)
Stoich.:	AB4C23D27 (1)
Weight, g/mol:	380.151826
ΔH_f, kcal/mol:	-145.52
Dipole, Da:	4.84
IP(EA), eV:	-9.37(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(benzimidazol-1-yl)-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]propanamide

Drug info:

PubChemData

Smile

C1CN(C[C@H]([C@@]1(CC2=CC=CC=C2)C(=O)O)O)C(=O)CCCC3=CC=CC=C3

DOS

IR

Vibrations