Geometry & MOs

Info

ID:	68006
PubChem CID:	46507594
Reduced:	FN2O4H13C18 (1)
Stoich.:	AB2C4D13E18 (1)
Weight, g/mol:	370.072035
ΔH_f, kcal/mol:	-100.04
Dipole, Da:	8.37
IP(EA), eV:	-8.9(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-[3-[(3-chloro-4-methylphenyl)carbamoyl]chromen-2-ylidene]amino] acetate

Drug info:

PubChemData

Smile

CC(=O)O/N=C\1/C(=CC2=CC=CC=C2O1)C(=O)NC3=CC(=CC=C3)F

DOS

IR

Vibrations