Geometry & MOs

Info

ID:	280440
PubChem CID:	103849289
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-142.1
Dipole, Da:	4.27
IP(EA), eV:	-8.92(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-hydroxyoxolan-3-yl)methyl]-3,5-dimethylbenzamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)/C=C/C(=O)NCC2(CCOC2)O

DOS

IR

Vibrations