Geometry & MOs

Info

ID:	34175
PubChem CID:	7890168
Reduced:	F2N3O4H13C15 (1)
Stoich.:	A2B3C4D13E15 (1)
Weight, g/mol:	365.068156
ΔH_f, kcal/mol:	-146.24
Dipole, Da:	5.8
IP(EA), eV:	-9.96(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4,5-dimethyl-2-[[2-(5-nitro-2-oxopyridin-1-yl)acetyl]amino]thiophene-3-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C1=C(C=C(C=C1)F)F)NC(=O)CN2C=C(C=CC2=O)[N+](=O)[O-]

DOS

IR

Vibrations