Geometry & MOs

Info

ID:	209656
PubChem CID:	80699669
Reduced:	ClFNC8H9 (1)
Stoich.:	ABCD8E9 (1)
Weight, g/mol:	209.141579
ΔH_f, kcal/mol:	-38.91
Dipole, Da:	2.76
IP(EA), eV:	-8.61(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,3-dimethyl-1-(prop-2-ynylamino)cyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)NCCF)Cl

DOS

IR

Vibrations