Geometry & MOs

Info

ID:	60938
PubChem CID:	26703363
Reduced:	NO4C24H27 (1)
Stoich.:	AB4C24D27 (1)
Weight, g/mol:	464.092119
ΔH_f, kcal/mol:	-134.96
Dipole, Da:	3.51
IP(EA), eV:	-8.75(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)CCC(=O)N2CCC[C@H]2C3=CC4=C(C=C3)OCCO4)C

DOS

IR

Vibrations