Geometry & MOs

Info

ID:	416785
PubChem CID:	135090351
Reduced:	ClON4C16H21 (1)
Stoich.:	ABC4D16E21 (1)
Weight, g/mol:	256.117155
ΔH_f, kcal/mol:	-4.24
Dipole, Da:	1.67
IP(EA), eV:	-9.12(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[2-hydroxyethyl(1H-imidazol-2-ylmethyl)amino]-2-oxoethoxy]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)C(=O)N(CCN(C)C)CC2=CN=CN2

DOS

IR

Vibrations