Geometry & MOs

Info

ID:	292400
PubChem CID:	115001282
Reduced:	N2O2C13H22 (1)
Stoich.:	A2B2C13D22 (1)
Weight, g/mol:	238.179361
ΔH_f, kcal/mol:	-83.92
Dipole, Da:	3.76
IP(EA), eV:	-9.1(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[(5-amino-2-methyl-1H-imidazol-4-yl)amino]-4-methylcyclohexyl]methanol

Drug info:

PubChemData

Smile

C1CCC(C1)(C(=O)O)NC2CCN(C2)C3CC3

DOS

IR

Vibrations