Geometry & MOs

Info

ID:	418222
PubChem CID:	135103896
Reduced:	ON2C8H11 (2)
Stoich.:	AB2C8D11 (2)
Weight, g/mol:	349.155705
ΔH_f, kcal/mol:	13.44
Dipole, Da:	4.61
IP(EA), eV:	-9.55(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N(C)CC2=CC3=NON=C3C=C2

DOS

IR

Vibrations