Geometry & MOs

Info

ID:	169277
PubChem CID:	75084264
Reduced:	NO2C17H19 (1)
Stoich.:	AB2C17D19 (1)
Weight, g/mol:	308.148455
ΔH_f, kcal/mol:	-49.52
Dipole, Da:	2.95
IP(EA), eV:	-9.35(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4,7,10-trimethyl-5-methylimino-9,11-dioxo-4,6,10-triazatricyclo[6.3.0.02,6]undecane-7-carboxylate

Drug info:

PubChemData

Smile

C1C2=C(C(N1)CCO)C(=CC(=C2)CO)C3=CC=CC=C3

DOS

IR

Vibrations