Geometry & MOs

Info

ID:	423365
PubChem CID:	135119378
Reduced:	NO4C18H25 (1)
Stoich.:	AB4C18D25 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	-187.81
Dipole, Da:	3.58
IP(EA), eV:	-9.18(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(3-methylimidazol-4-yl)methyl]-4-phenylbutanamide

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C(=O)CC3=CC=CC=C3O)O

DOS

IR

Vibrations