Geometry & MOs

Info

ID:	198651
PubChem CID:	79130601
Reduced:	SN3C17H23 (1)
Stoich.:	AB3C17D23 (1)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	35.64
Dipole, Da:	2.26
IP(EA), eV:	-8.11(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropyl-3-hydroxypyrrolidin-3-yl)-3-methylcyclopentane-1-carbonitrile

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N)SCC2=NN(C=C2)C3CCCCC3

DOS

IR

Vibrations