Geometry & MOs

Info

ID:	304503
PubChem CID:	124756088
Reduced:	NO3C19H21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	311.152144
ΔH_f, kcal/mol:	-87.4
Dipole, Da:	2.74
IP(EA), eV:	-8.77(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]ethyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CNC(=O)CC1=CC=C(C=C1)CC[C@@H]2COC3=CC=CC=C3O2

DOS

IR

Vibrations