Geometry & MOs

Info

ID:	158842
PubChem CID:	56479557
Reduced:	SO4N5C19H25 (1)
Stoich.:	AB4C5D19E25 (1)
Weight, g/mol:	430.053625
ΔH_f, kcal/mol:	-119.48
Dipole, Da:	12.18
IP(EA), eV:	-9.2(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[(5-chlorothiophen-2-yl)sulfonyl-methylamino]acetyl]-methylamino]-N-(4-methylpyridin-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=NC=C1)NC(=O)CN(C)C(=O)C2=CC(=CN2C)S(=O)(=O)N3CCCC3

DOS

IR

Vibrations