Geometry & MOs

Info

ID:	365196
PubChem CID:	127317013
Reduced:	O2N6C19H24 (1)
Stoich.:	A2B6C19D24 (1)
Weight, g/mol:	322.236876
ΔH_f, kcal/mol:	-19.49
Dipole, Da:	3.54
IP(EA), eV:	-8.79(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-tert-butyl-5-methylpyrazol-3-yl)-2-[methyl(oxan-3-ylmethyl)amino]acetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)CC(=O)N3CC(=O)NC4=CC=CC=C43

DOS

IR

Vibrations