Geometry & MOs

Info

ID:	285595
PubChem CID:	104115173
Reduced:	NOC5H8 (2)
Stoich.:	ABC5D8 (2)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-67.91
Dipole, Da:	4.19
IP(EA), eV:	-8.74(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3-oxazol-4-yl]methanol

Drug info:

PubChemData

Smile

CC1CCCCN1C2=NC(=CO2)CO

DOS

IR

Vibrations