Geometry & MOs

Info

ID:	68048
PubChem CID:	46507662
Reduced:	ClN2O4H15C18 (1)
Stoich.:	AB2C4D15E18 (1)
Weight, g/mol:	326.126657
ΔH_f, kcal/mol:	-109.37
Dipole, Da:	3.19
IP(EA), eV:	-9.55(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-N-(4-ethoxyphenyl)-2-hydroxyimino-3,4-dihydrochromene-3-carboxamide

Drug info:

PubChemData

Smile

CC1=NC=C(C2=C1OC(=O)C(=C2)C(=O)NCC3=CC=CC=C3Cl)CO

DOS

IR

Vibrations