Geometry & MOs

Info

ID:	348306
PubChem CID:	127273371
Reduced:	ON3C9H10 (2)
Stoich.:	AB3C9D10 (2)
Weight, g/mol:	369.18009
ΔH_f, kcal/mol:	-15.44
Dipole, Da:	2.96
IP(EA), eV:	-9.32(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-methyl-3-oxo-1,4-benzoxazin-4-yl)-N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)propanamide

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N(C=N2)CC(=O)NC3CCC4=NC(=NN4C3)C

DOS

IR

Vibrations