Geometry & MOs

Info

ID:	201873
PubChem CID:	79594549
Reduced:	SN2O3C8H16 (1)
Stoich.:	AB2C3D8E16 (1)
Weight, g/mol:	333.10921
ΔH_f, kcal/mol:	-114.56
Dipole, Da:	5.5
IP(EA), eV:	-10.21(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-bromonaphthalen-1-yl)-N,3,3-trimethylpentan-1-amine

Drug info:

PubChemData

Smile

CC(C)OCCS(=O)(=O)NCCC#N

DOS

IR

Vibrations