Geometry & MOs

Info

ID:	307720
PubChem CID:	125308586
Reduced:	N2O3C22H22 (1)
Stoich.:	A2B3C22D22 (1)
Weight, g/mol:	378.251858
ΔH_f, kcal/mol:	3.5
Dipole, Da:	7.07
IP(EA), eV:	-8.33(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,3S,4S,5S,8S,10R,14R)-10,14-dimethyl-5-[(2-morpholin-4-ylethylamino)methyl]-2,7-dioxatetracyclo[8.4.0.01,3.04,8]tetradecan-6-one

Drug info:

PubChemData

Smile

CN1CCC2=C3C=CC=CC3=N[C@@H]2C(=C1)C(=O)C4=CC(=C(C=C4)OC)OC

DOS

IR

Vibrations