Geometry & MOs

Info

ID:	33583
PubChem CID:	7887080
Reduced:	O2S2N4C19H20 (1)
Stoich.:	A2B2C4D19E20 (1)
Weight, g/mol:	389.083014
ΔH_f, kcal/mol:	-37.17
Dipole, Da:	2.18
IP(EA), eV:	-8.95(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-chloro-4-methyl-2-oxochromen-7-yl)oxy-N-ethyl-N-(4-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)NC(=O)CSC2=NC=NC3=C2C(=C(S3)C)C)C

DOS

IR

Vibrations