Geometry & MOs

Info

ID:	351065
PubChem CID:	127279502
Reduced:	SO3N4C19H30 (1)
Stoich.:	AB3C4D19E30 (1)
Weight, g/mol:	394.131091
ΔH_f, kcal/mol:	-109.85
Dipole, Da:	9.71
IP(EA), eV:	-8.45(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methoxy-5-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-methyl-1,2-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN1C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCN(CC3)C

DOS

IR

Vibrations