Geometry & MOs

Info

ID:	449780
PubChem CID:	135301396
Reduced:	OC11H18 (1)
Stoich.:	AB11C18 (1)
Weight, g/mol:	426.170844
ΔH_f, kcal/mol:	-49.26
Dipole, Da:	2.43
IP(EA), eV:	-9.25(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-dimethoxyphosphoryl-N,N-diethyl-3-imino-5,6-dihydrobenzo[c]xanthen-10-amine

Drug info:

PubChemData

Smile

CC\1(CC[C@@H](C/C1=C/C=C)O)C

DOS

IR

Vibrations