Geometry & MOs

Info

ID:	286649
PubChem CID:	104179603
Reduced:	FNC16H20 (1)
Stoich.:	ABC16D20 (1)
Weight, g/mol:	241.18305
ΔH_f, kcal/mol:	6.65
Dipole, Da:	3.16
IP(EA), eV:	-9.04(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-hex-5-yn-3-yl-3-(2-methylphenyl)cyclobutan-1-amine

Drug info:

PubChemData

Smile

CCC(CC#C)NC1CC(C1)C2=CC=C(C=C2)F

DOS

IR

Vibrations