Geometry & MOs

Info

ID:	255518
PubChem CID:	103132670
Reduced:	NC5H9 (3)
Stoich.:	AB5C9 (3)
Weight, g/mol:	250.120509
ΔH_f, kcal/mol:	1.18
Dipole, Da:	3.68
IP(EA), eV:	-8.53(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(5-methyloxolan-2-yl)methoxy]phenyl]acetic acid

Drug info:

PubChemData

Smile

CC1CCC(C(C1)C2=NN(C=C2)C)CNC(C)C

DOS

IR

Vibrations