Geometry & MOs

Info

ID:	422217
PubChem CID:	135117428
Reduced:	N2O2C23H26 (1)
Stoich.:	A2B2C23D26 (1)
Weight, g/mol:	287.163377
ΔH_f, kcal/mol:	-20.42
Dipole, Da:	5.12
IP(EA), eV:	-8.81(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-(3-methylphenyl)acetamide

Drug info:

PubChemData

Smile

C1[C@H]([C@@H](CN1CCOCC2=CC=CC=C2)O)CC3=NC4=CC=CC=C4C=C3

DOS

IR

Vibrations