Geometry & MOs

Info

ID:	216528
PubChem CID:	85086372
Reduced:	NOC19H19 (1)
Stoich.:	ABC19D19 (1)
Weight, g/mol:	277.050571
ΔH_f, kcal/mol:	24.16
Dipole, Da:	3.54
IP(EA), eV:	-8.4(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(5-chloro-3-phenyl-1,2-oxazol-4-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(C(C2=O)(C)C=C)C3=CC=CC=C3

DOS

IR

Vibrations