Geometry & MOs

Info

ID:	266631
PubChem CID:	103576503
Reduced:	SN2O2F3C12H15 (1)
Stoich.:	AB2C2D3E12F15 (1)
Weight, g/mol:	168.162649
ΔH_f, kcal/mol:	-218.83
Dipole, Da:	7.39
IP(EA), eV:	-9.39(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-1-pent-4-enylpyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC1CN(CC1N)S(=O)(=O)C2=CC=CC=C2C(F)(F)F

DOS

IR

Vibrations