Geometry & MOs

Info

ID:	370466
PubChem CID:	127338983
Reduced:	SN3O4C17H23 (1)
Stoich.:	AB3C4D17E23 (1)
Weight, g/mol:	352.211055
ΔH_f, kcal/mol:	-152.71
Dipole, Da:	9.83
IP(EA), eV:	-9.11(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methyl-2-oxopyrrolidin-3-yl)-3-[4-(oxolane-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NC3CCN(C3=O)C

DOS

IR

Vibrations