Geometry & MOs

Info

ID:	280433
PubChem CID:	103849258
Reduced:	N3O5C12H19 (1)
Stoich.:	A3B5C12D19 (1)
Weight, g/mol:	265.111422
ΔH_f, kcal/mol:	-233.05
Dipole, Da:	2.81
IP(EA), eV:	-9.73(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(3-fluorophenyl)-N-[(3-hydroxyoxolan-3-yl)methyl]prop-2-enamide

Drug info:

PubChemData

Smile

CC1(C(=O)N(C(=O)N1)CC(=O)NCC2(CCOC2)O)C

DOS

IR

Vibrations