Geometry & MOs

Info

ID:	289365
PubChem CID:	104347368
Reduced:	OSN8C11H12 (1)
Stoich.:	ABC8D11E12 (1)
Weight, g/mol:	254.120132
ΔH_f, kcal/mol:	104.7
Dipole, Da:	4.16
IP(EA), eV:	-9.43(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-cyclopentylsulfanyl-2-(methoxymethyl)pyrimidin-4-yl]hydrazine

Drug info:

PubChemData

Smile

COCC1=NC(=CC(=N1)SC2=NC=NC3=C2NC=N3)NN

DOS

IR

Vibrations