Geometry & MOs

Info

ID:	14584
PubChem CID:	415398
Reduced:	O2N5C9H13 (1)
Stoich.:	A2B5C9D13 (1)
Weight, g/mol:	223.106925
ΔH_f, kcal/mol:	-19.66
Dipole, Da:	3.46
IP(EA), eV:	-8.87(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]methylideneamino]guanidine

Drug info:

PubChemData

Smile

CC1=NC=C(C(=C1O)C=NN=C(N)N)CO

DOS

IR

Vibrations