Geometry & MOs

Info

ID:	352883
PubChem CID:	127283973
Reduced:	SN3O5C18H25 (1)
Stoich.:	AB3C5D18E25 (1)
Weight, g/mol:	392.115441
ΔH_f, kcal/mol:	-218.52
Dipole, Da:	1.91
IP(EA), eV:	-9.39(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1,1-dioxo-1,4-thiazinan-4-yl)-1-oxopropan-2-yl]-2-(4-oxoquinazolin-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NCC(=O)NC(C)C(=O)N2CCS(=O)(=O)CC2)C

DOS

IR

Vibrations