Geometry & MOs

Info

ID:	203727
PubChem CID:	79862079
Reduced:	NOSF2C15H23 (1)
Stoich.:	ABCD2E15F23 (1)
Weight, g/mol:	222.173213
ΔH_f, kcal/mol:	-147.6
Dipole, Da:	3.38
IP(EA), eV:	-9.15(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-ethylpyrazol-4-yl)methyl]-2,2-dimethylcyclopentan-1-ol

Drug info:

PubChemData

Smile

CC1(CCCCC1NCC2=CC=C(O2)CSC(F)F)C

DOS

IR

Vibrations