Geometry & MOs

Info

ID:	142524
PubChem CID:	53049849
Reduced:	ClO3N4H23C27 (1)
Stoich.:	AB3C4D23E27 (1)
Weight, g/mol:	462.172562
ΔH_f, kcal/mol:	-12.03
Dipole, Da:	5.16
IP(EA), eV:	-8.37(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(2-methoxyphenyl)methylcarbamoyl]phenyl]-6,8-dimethyl-2,3-dihydropyrido[2,3-b][1,4]thiazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CN3C(=O)CCN4C3=CC(=N4)C5=CC(=CC=C5)Cl

DOS

IR

Vibrations