Geometry & MOs

Info

ID:	365067
PubChem CID:	127316781
Reduced:	OF2N2C15H18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	369.172228
ΔH_f, kcal/mol:	-115.31
Dipole, Da:	4.87
IP(EA), eV:	-8.76(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxothiolan-3-yl)-4-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine-2-carbonyl)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C3=C(C=CC=C3F)F

DOS

IR

Vibrations