Geometry & MOs

Info

ID:	349340
PubChem CID:	127275127
Reduced:	NO2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	280.189926
ΔH_f, kcal/mol:	-154.51
Dipole, Da:	3.66
IP(EA), eV:	-8.27(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methyl-1,4-oxazepan-4-yl)-N-(1,3,5-trimethylpyrazol-4-yl)acetamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)CC(=O)N2CCCC2C3=C(C=CC(=C3)OC)OC

DOS

IR

Vibrations