Geometry & MOs

Info

ID:	421123
PubChem CID:	135115406
Reduced:	NO4C20H29 (1)
Stoich.:	AB4C20D29 (1)
Weight, g/mol:	317.173942
ΔH_f, kcal/mol:	-178.51
Dipole, Da:	6.71
IP(EA), eV:	-8.73(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OC2CCN(CC2)C(=O)[C@@H]3CC[C@@H]([C@@H](C3)OC)O

DOS

IR

Vibrations