Geometry & MOs

Info

ID:	416209
PubChem CID:	135089219
Reduced:	SO2N4C18H24 (1)
Stoich.:	AB2C4D18E24 (1)
Weight, g/mol:	358.200491
ΔH_f, kcal/mol:	-44.28
Dipole, Da:	7.06
IP(EA), eV:	-9.35(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-benzodioxol-5-yl)-N-[2-(dimethylamino)ethyl]-N-[(5-methyl-1H-imidazol-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC(C)(C(=O)NCC1=NNC2=C1CCCCC2)NC(=O)C3=CC=CS3

DOS

IR

Vibrations