Geometry & MOs

Info

ID:	196615
PubChem CID:	78854153
Reduced:	N3O3C16H21 (1)
Stoich.:	A3B3C16D21 (1)
Weight, g/mol:	305.119798
ΔH_f, kcal/mol:	-98.11
Dipole, Da:	6.62
IP(EA), eV:	-9.15(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-hydroxypropyl)-2-[1-(2-methylphenyl)imidazol-2-yl]sulfanylacetamide

Drug info:

PubChemData

Smile

C1CN(N=C1C2=CC=CC=C2)C(=O)CCC(=O)NCCCO

DOS

IR

Vibrations