Geometry & MOs

Info

ID:	139156
PubChem CID:	52483314
Reduced:	FNO2C19H22 (1)
Stoich.:	ABC2D19E22 (1)
Weight, g/mol:	396.106984
ΔH_f, kcal/mol:	-100.46
Dipole, Da:	3.86
IP(EA), eV:	-8.35(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

imidazo[1,2-a]pyridin-2-ylmethyl 4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanoate

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(CCC2)C[C@H](COC3=CC=C(C=C3)F)O

DOS

IR

Vibrations