Geometry & MOs

Info

ID:	343057
PubChem CID:	127266230
Reduced:	NO3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	361.21139
ΔH_f, kcal/mol:	-82.24
Dipole, Da:	1.77
IP(EA), eV:	-9.31(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropyl)-N-[4-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-yl]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCCCCOCC(=O)NOC1=CC=CC=C1

DOS

IR

Vibrations