Geometry & MOs

Info

ID:	230410
PubChem CID:	87570819
Reduced:	NO5C25H31 (1)
Stoich.:	AB5C25D31 (1)
Weight, g/mol:	342.303499
ΔH_f, kcal/mol:	-148.8
Dipole, Da:	0.47
IP(EA), eV:	-9.02(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-6-(cyclohexylmethyl)-3,5-diethylbenzene-1,4-diamine

Drug info:

PubChemData

Smile

CC(=NOCCCCC1COC(OC1)(C)C(=O)OC)C2=CC=C(C=C2)C3=CC=CC=C3

DOS

IR

Vibrations