Geometry & MOs

Info

ID:	416728
PubChem CID:	135090181
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	351.134969
ΔH_f, kcal/mol:	-44.46
Dipole, Da:	4.85
IP(EA), eV:	-8.64(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=O)N1)C(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C

DOS

IR

Vibrations