Geometry & MOs

Info

ID:	418470
PubChem CID:	135105028
Reduced:	N2O2C21H28 (1)
Stoich.:	A2B2C21D28 (1)
Weight, g/mol:	347.184506
ΔH_f, kcal/mol:	-66.33
Dipole, Da:	2.69
IP(EA), eV:	-8.58(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-diethoxy-N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC2=NC(=C(C=C2C=C1)CO)N3CCC[C@@]4(C3)CCC[C@H]4OC

DOS

IR

Vibrations