Geometry & MOs

Info

ID:	201906
PubChem CID:	79602695
Reduced:	ON2C15H20 (1)
Stoich.:	AB2C15D20 (1)
Weight, g/mol:	329.08128
ΔH_f, kcal/mol:	-17.95
Dipole, Da:	2.9
IP(EA), eV:	-9.22(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromothiophen-3-yl)-(4-tert-butylcyclohexyl)methanamine

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)N=C(O2)C(C3CCCCC3)N

DOS

IR

Vibrations