Geometry & MOs

Info

ID:	132474
PubChem CID:	51367875
Reduced:	N2O3H22C25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	429.132471
ΔH_f, kcal/mol:	-23.71
Dipole, Da:	3.59
IP(EA), eV:	-8.61(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[3-[(6-methylpyridin-2-yl)carbamoyl]-7-oxochromen-2-yl]amino]benzoate

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N=C2C(=CC3=CC=CC=C3O2)C(=O)NC4=CC=CC=C4C

DOS

IR

Vibrations