Geometry & MOs

Info

ID:	205257
PubChem CID:	80076477
Reduced:	SN2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	217.18305
ΔH_f, kcal/mol:	22.91
Dipole, Da:	2.06
IP(EA), eV:	-8.95(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-4-(1,2,3,4-tetrahydronaphthalen-1-yl)butan-2-amine

Drug info:

PubChemData

Smile

CC(CC1=NC2=CC=CC=C2S1)C(C)N

DOS

IR

Vibrations