Geometry & MOs

Info

ID:	216163
PubChem CID:	85085818
Reduced:	N2O3C12H18 (1)
Stoich.:	A2B3C12D18 (1)
Weight, g/mol:	236.127326
ΔH_f, kcal/mol:	-126.8
Dipole, Da:	5.64
IP(EA), eV:	-9.79(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-aminoanilino)-6-(hydroxymethyl)-1,4,5,6-tetrahydropyrimidin-5-ol

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2CC3C(C2)C3CO

DOS

IR

Vibrations