Geometry & MOs

Info

ID:	58623
PubChem CID:	24712317
Reduced:	O2N3C20H21 (1)
Stoich.:	A2B3C20D21 (1)
Weight, g/mol:	319.14514
ΔH_f, kcal/mol:	19.95
Dipole, Da:	2.06
IP(EA), eV:	-9.14(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(3-chlorophenyl)methyl]imidazol-2-yl]methyl]-N-(2-methylpropyl)acetamide

Drug info:

PubChemData

Smile

C1CC1C(=O)N(CC2=CC=CO2)CC3=NC=CN3CC4=CC=CC=C4

DOS

IR

Vibrations