Geometry & MOs

Info

ID:	206944
PubChem CID:	80322964
Reduced:	BrNO2C14H26 (1)
Stoich.:	ABC2D14E26 (1)
Weight, g/mol:	253.186421
ΔH_f, kcal/mol:	-85.01
Dipole, Da:	3.22
IP(EA), eV:	-8.81(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N-[(3-methylthiophen-2-yl)methyl]heptan-1-amine

Drug info:

PubChemData

Smile

CN(CCOCC1CC1)CC2(CCOCC2)CBr

DOS

IR

Vibrations