Geometry & MOs

Info

ID:	204469
PubChem CID:	79968190
Reduced:	N3O3H13C14 (1)
Stoich.:	A3B3C13D14 (1)
Weight, g/mol:	226.142976
ΔH_f, kcal/mol:	-15.53
Dipole, Da:	4.92
IP(EA), eV:	-9.94(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-(2-methoxyethyl)-7-methyl-1,3,7-triazaspiro[4.4]non-3-en-2-one

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C2C(=NC(=O)N2CC#C)N

DOS

IR

Vibrations