Geometry & MOs

Info

ID:	34395
PubChem CID:	7891068
Reduced:	FOS2N4C19H19 (1)
Stoich.:	ABC2D4E19F19 (1)
Weight, g/mol:	376.081912
ΔH_f, kcal/mol:	-0.34
Dipole, Da:	5.79
IP(EA), eV:	-8.83(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(2-fluorophenyl)carbamoylamino]-2-oxoethyl] 4-amino-3-nitrobenzoate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)NC2=NN=C(S2)SCC(=O)NC3=CC(=C(C=C3)C)F

DOS

IR

Vibrations