Geometry & MOs

Info

ID:	155865
PubChem CID:	56367990
Reduced:	SN4O5C24H26 (1)
Stoich.:	AB4C5D24E26 (1)
Weight, g/mol:	462.157306
ΔH_f, kcal/mol:	-123.21
Dipole, Da:	5.5
IP(EA), eV:	-8.71(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-3-morpholin-4-ylsulfonyl-N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]benzamide

Drug info:

PubChemData

Smile

CN(C1=CC=C(C=C1)OC)S(=O)(=O)C2=CC=CC(=C2)C(=O)NCCC(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations