Geometry & MOs

Info

ID:	340375
PubChem CID:	127262386
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	283.157229
ΔH_f, kcal/mol:	-61.81
Dipole, Da:	4.95
IP(EA), eV:	-9.45(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(aminomethyl)naphthalen-2-yl] cyclohexanecarboxylate

Drug info:

PubChemData

Smile

C1CCC(CC1)C(=O)OC2=CC=C(C=C2)C(=N)N

DOS

IR

Vibrations