Geometry & MOs

Info

ID:	159241
PubChem CID:	57265778
Reduced:	SN3O4C17H19 (1)
Stoich.:	AB3C4D17E19 (1)
Weight, g/mol:	155.069477
ΔH_f, kcal/mol:	-116.95
Dipole, Da:	2.96
IP(EA), eV:	-8.57(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxyethyl)imidazole-1-carboxamide

Drug info:

PubChemData

Smile

CC1[C@@H](O[C@@H](C1O)CO)N2C=CC(=NC2=S)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations