Geometry & MOs

Info

ID:	270041
PubChem CID:	103623752
Reduced:	ClO2N3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	269.173942
ΔH_f, kcal/mol:	-13.08
Dipole, Da:	0.32
IP(EA), eV:	-8.75(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-2-(2-methoxyethoxy)acetamide

Drug info:

PubChemData

Smile

CN(C)CCN(CC1=CN=CC=C1)C(=O)C2=CC=C(O2)Cl

DOS

IR

Vibrations