Geometry & MOs

Info

ID:	352239
PubChem CID:	127283321
Reduced:	SN2O5C15H20 (1)
Stoich.:	AB2C5D15E20 (1)
Weight, g/mol:	253.179027
ΔH_f, kcal/mol:	-183.62
Dipole, Da:	8.75
IP(EA), eV:	-9.07(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylcyclopropyl)-4-(2-methylpropanoyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)CNC(=O)N3CCS(=O)(=O)CC3)OC1

DOS

IR

Vibrations