Geometry & MOs

Info

ID:	420512
PubChem CID:	135113543
Reduced:	O3N5C19H23 (1)
Stoich.:	A3B5C19D23 (1)
Weight, g/mol:	348.161997
ΔH_f, kcal/mol:	-62.71
Dipole, Da:	6.66
IP(EA), eV:	-8.98(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-(1H-imidazol-5-ylmethyl)-2-(3-methoxyphenyl)sulfanylacetamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=O)N2CCC(=O)N3CCC(CC3)C4=NN=CN4C

DOS

IR

Vibrations