Geometry & MOs

Info

ID:	15146
PubChem CID:	430747
Reduced:	N3O6C31H51 (1)
Stoich.:	A3B6C31D51 (1)
Weight, g/mol:	561.377786
ΔH_f, kcal/mol:	-288.67
Dipole, Da:	8.98
IP(EA), eV:	-9.25(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(10-imino-5-undecanoyloxy-3,7-dioxa-1,9-diazatricyclo[6.4.0.02,6]dodeca-8,11-dien-4-yl)methyl undecanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCC(=O)OCC1C(C2C(O1)N3C=CC(=N)N=C3O2)OC(=O)CCCCCCCCCC

DOS

IR

Vibrations