Geometry & MOs

Info

ID:	441159
PubChem CID:	135233372
Reduced:	O2N5C26H41 (1)
Stoich.:	A2B5C26D41 (1)
Weight, g/mol:	309.194008
ΔH_f, kcal/mol:	-59.32
Dipole, Da:	4.38
IP(EA), eV:	-8.03(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1E,6Z,8Z)-8-hydroxy-5,9,11-trimethyl-1-(methylamino)-10-oxododeca-1,6,8-trien-6-yl] formate

Drug info:

PubChemData

Smile

CC(C)C1=CC(=NO1)C(=O)NC2CC(CCC2(C)C)C3=NC(=C(C=C3)NCC(C)(C)C)NC

DOS

IR

Vibrations