Geometry & MOs

Info

ID:	183483
PubChem CID:	77028438
Reduced:	ON6C12H16 (1)
Stoich.:	AB6C12D16 (1)
Weight, g/mol:	243.194677
ΔH_f, kcal/mol:	75.23
Dipole, Da:	6.2
IP(EA), eV:	-9.14(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-hydroxy-4-[[1-(hydroxymethyl)-4-methylcyclohexyl]amino]butanimidamide

Drug info:

PubChemData

Smile

CN1C=NN=C1CNCC2=CC=C(C=C2)C(=NO)N

DOS

IR

Vibrations