Geometry & MOs

Info

ID:	68489
PubChem CID:	46508514
Reduced:	S2N3O4C22H27 (1)
Stoich.:	A2B3C4D22E27 (1)
Weight, g/mol:	480.150112
ΔH_f, kcal/mol:	-120.13
Dipole, Da:	4.4
IP(EA), eV:	-8.61(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(2,6-dimethylmorpholin-4-yl)sulfonylanilino]-N-(2-thiophen-2-ylethylcarbamoyl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)N3CCSC4=CC=CC=C43

DOS

IR

Vibrations