Geometry & MOs

Info

ID:	293026
PubChem CID:	117370618
Reduced:	O2N3C13H17 (1)
Stoich.:	A2B3C13D17 (1)
Weight, g/mol:	247.132077
ΔH_f, kcal/mol:	-47.48
Dipole, Da:	5.22
IP(EA), eV:	-8.92(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(1-amino-2-hydroxyethyl)phenyl]-1,4-dimethylimidazol-2-one

Drug info:

PubChemData

Smile

CN1CCN(CC1=O)C2=CC=C(C=C2)C(=O)CN

DOS

IR

Vibrations