Geometry & MOs

Info

ID:	446438
PubChem CID:	135274994
Reduced:	NO2F3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	149.101606
ΔH_f, kcal/mol:	-218.85
Dipole, Da:	4.45
IP(EA), eV:	-9.08(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,2-difluoro-N-propylbut-3-en-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC[C@@H](C=C1)C2=CC(=C(C(=C2)F)F)F

DOS

IR

Vibrations