Geometry & MOs

Info

ID:	144601
PubChem CID:	53387982
Reduced:	N3O3C14H17 (1)
Stoich.:	A3B3C14D17 (1)
Weight, g/mol:	305.137556
ΔH_f, kcal/mol:	-76.68
Dipole, Da:	6.96
IP(EA), eV:	-8.66(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[2-[4-(2-hydroxyethyl)piperazin-1-yl]acetyl]-3H-1,3-benzoxazol-2-one

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(=O)C2=CC3=C(C=C2)NC(=O)O3

DOS

IR

Vibrations