Geometry & MOs

Info

ID:	346787
PubChem CID:	127271291
Reduced:	SN3O4C19H29 (1)
Stoich.:	AB3C4D19E29 (1)
Weight, g/mol:	319.200825
ΔH_f, kcal/mol:	-172.67
Dipole, Da:	4.75
IP(EA), eV:	-9.06(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(oxolan-2-yl)propan-2-yl]-4-pyrazin-2-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NC(C)CC3CCCO3

DOS

IR

Vibrations