Geometry & MOs

Info

ID:	294328
PubChem CID:	117453311
Reduced:	BrNC14H20 (1)
Stoich.:	ABC14D20 (1)
Weight, g/mol:	281.07791
ΔH_f, kcal/mol:	-0.76
Dipole, Da:	1.53
IP(EA), eV:	-9.16(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2-bromo-5-methylphenyl)cyclohexyl]methanamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2(CCCCC2)CN)Br

DOS

IR

Vibrations