Geometry & MOs

Info

ID:	202478
PubChem CID:	79679337
Reduced:	BrNSC13H18 (1)
Stoich.:	ABCD13E18 (1)
Weight, g/mol:	205.146664
ΔH_f, kcal/mol:	6.81
Dipole, Da:	1.49
IP(EA), eV:	-8.95(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methoxyphenyl)-2-methylcyclopentan-1-amine

Drug info:

PubChemData

Smile

CC1CCCC1(CN)SC2=CC=CC=C2Br

DOS

IR

Vibrations