Geometry & MOs

Info

ID:	365096
PubChem CID:	127316838
Reduced:	SN3O4C19H29 (1)
Stoich.:	AB3C4D19E29 (1)
Weight, g/mol:	288.195011
ΔH_f, kcal/mol:	-156.59
Dipole, Da:	6.88
IP(EA), eV:	-8.38(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-cyclopropyl-1-methylpyrazol-4-yl)-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)methanone

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)CS(=O)(=O)NC3=CC=C(C=C3)OC(C)C

DOS

IR

Vibrations