Geometry & MOs

Info

ID:	360806
PubChem CID:	127301451
Reduced:	SN2O4C10H16 (1)
Stoich.:	AB2C4D10E16 (1)
Weight, g/mol:	356.151826
ΔH_f, kcal/mol:	-116.66
Dipole, Da:	3.53
IP(EA), eV:	-9.84(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[4-[(5-methyl-1,2-oxazol-3-yl)methylsulfonyl]piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1CN(CCO1)S(=O)(=O)CC2=CC(=NO2)C

DOS

IR

Vibrations