Geometry & MOs

Info

ID:	194460
PubChem CID:	78540548
Reduced:	FNO5H18C20 (1)
Stoich.:	ABC5D18E20 (1)
Weight, g/mol:	330.101585
ΔH_f, kcal/mol:	-200.41
Dipole, Da:	6.55
IP(EA), eV:	-9.68(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(1-methylpyrrole-2-carbonyl)amino]-2-oxoethyl] 3-(3-fluorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)C=CC2=CC(=CC=C2)F

DOS

IR

Vibrations