Geometry & MOs

Info

ID:	344901
PubChem CID:	127268661
Reduced:	SN3O4C19H29 (1)
Stoich.:	AB3C4D19E29 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-157.12
Dipole, Da:	5.95
IP(EA), eV:	-9.07(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-methyl-4-(oxolan-2-ylmethylsulfonyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CC=CC=C1)C(=O)N2CCN(CC2)S(=O)(=O)CC3CCCCO3

DOS

IR

Vibrations