Geometry & MOs

Info

ID:	132658
PubChem CID:	51394711
Reduced:	NOC11H16 (1)
Stoich.:	ABC11D16 (1)
Weight, g/mol:	386.17593
ΔH_f, kcal/mol:	-33.88
Dipole, Da:	3.35
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 1.106481
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-methylfuran-2-yl)-[(Z)-(1,3,3-trimethylindol-2-ylidene)methyl]phosphoryl]morpholine

Drug info:

PubChemData

Smile

CC(C)(C)[NH+]=CC1=CC=C(C=C1)O

DOS

IR

Vibrations