Geometry & MOs

Info

ID:	197268
PubChem CID:	78945268
Reduced:	N2O2C11H20 (1)
Stoich.:	A2B2C11D20 (1)
Weight, g/mol:	225.147727
ΔH_f, kcal/mol:	-92.31
Dipole, Da:	1.86
IP(EA), eV:	-8.55(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(1-pyrazol-1-ylpropan-2-ylamino)butanoate

Drug info:

PubChemData

Smile

COC(=O)CCN1CCN2CCCC2C1

DOS

IR

Vibrations