Geometry & MOs

Info

ID:	69657
PubChem CID:	47205096
Reduced:	ON3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	275.126991
ΔH_f, kcal/mol:	-47.12
Dipole, Da:	5.69
IP(EA), eV:	-9.65(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethoxyphenyl)-N-(1H-pyrazol-5-ylmethyl)acetamide

Drug info:

PubChemData

Smile

CC(C)(C)C1CCC(CC1)C(=O)NCC2=CC=NN2

DOS

IR

Vibrations