Geometry & MOs

Info

ID:	19301
PubChem CID:	560423
Reduced:	O3C9H14 (1)
Stoich.:	A3B9C14 (1)
Weight, g/mol:	170.094294
ΔH_f, kcal/mol:	-112.56
Dipole, Da:	2.53
IP(EA), eV:	-9.99(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(cyclobuten-1-yl)-3-hydroxy-2-methylpropanoate

Drug info:

PubChemData

Smile

CC(C(C1=CCC1)O)C(=O)OC

DOS

IR

Vibrations