Geometry & MOs

Info

ID:	68032
PubChem CID:	46507632
Reduced:	FNO2H6C9 (2)
Stoich.:	ABC2D6E9 (2)
Weight, g/mol:	372.092163
ΔH_f, kcal/mol:	-143.63
Dipole, Da:	9.84
IP(EA), eV:	-8.94(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(Z)-[3-[(3,4-difluorophenyl)carbamoyl]chromen-2-ylidene]amino] propanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations