Geometry & MOs

Info

ID:	307618
PubChem CID:	125307775
Reduced:	N3O5C25H31 (1)
Stoich.:	A3B5C25D31 (1)
Weight, g/mol:	384.056212
ΔH_f, kcal/mol:	-117.36
Dipole, Da:	4.29
IP(EA), eV:	-8.83(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(4-methoxy-6-oxo-5H-pyrimidin-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)propanamide

Drug info:

PubChemData

Smile

C1CN(CCN1CCOCCO)[C@H](C2=C3C=C(C=CC3=NC2)OCC4=CC=CC=C4)C(=O)O

DOS

IR

Vibrations