Geometry & MOs

Info

ID:	176631
PubChem CID:	76075910
Reduced:	N3O8C41H51 (1)
Stoich.:	A3B8C41D51 (1)
Weight, g/mol:	412.26136
ΔH_f, kcal/mol:	-285.22
Dipole, Da:	2.9
IP(EA), eV:	-8.54(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1COCC1OC(=O)NC(CC2=CC=CC=C2)C(CCC(=O)N(CC=CC3=CC=C(C=C3)OCCN4CCOCC4)C5C(CC6=CC=CC=C56)O)O

DOS

IR

Vibrations