Geometry & MOs

Info

ID:	235272
PubChem CID:	92304317
Reduced:	N2O3C23H26 (1)
Stoich.:	A2B3C23D26 (1)
Weight, g/mol:	357.9953
ΔH_f, kcal/mol:	-72.26
Dipole, Da:	5.66
IP(EA), eV:	-8.28(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-2-(2-bromo-4-methoxyphenyl)-4-(pyridin-3-ylmethylidene)-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CCCNC(=O)C[C@@H](C1=CC2=C(C=C1)OCO2)C3=CN(C4=CC=CC=C43)CC

DOS

IR

Vibrations