Geometry & MOs

Info

ID:	353944
PubChem CID:	127285584
Reduced:	N3O4C15H19 (1)
Stoich.:	A3B4C15D19 (1)
Weight, g/mol:	346.109962
ΔH_f, kcal/mol:	-137.68
Dipole, Da:	2.75
IP(EA), eV:	-8.82(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(2-methyl-4-oxo-1H-pyrimidin-6-yl)phenyl]-1-oxo-1,4-thiazinane-4-carboxamide

Drug info:

PubChemData

Smile

CC1C(=O)NCCN1C(=O)NCC2COC3=CC=CC=C3O2

DOS

IR

Vibrations