Geometry & MOs

Info

ID:	423270
PubChem CID:	135119219
Reduced:	SO2N3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	319.153206
ΔH_f, kcal/mol:	-44.87
Dipole, Da:	6.39
IP(EA), eV:	-8.61(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(6-methoxy-1,3-benzodioxol-5-yl)methyl-[(5-methyl-1H-imidazol-4-yl)methyl]amino]ethanol

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=CC=C1NC(=O)CN(C)CC2=CC(=CC=C2)SC

DOS

IR

Vibrations