Geometry & MOs

Info

ID:	217863
PubChem CID:	85088503
Reduced:	PN5O6C16H22 (1)
Stoich.:	AB5C6D16E22 (1)
Weight, g/mol:	407.144098
ΔH_f, kcal/mol:	-249.89
Dipole, Da:	7.97
IP(EA), eV:	-9.65(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4,11-dicarbamoyl-6,9-dimethoxy-14-oxa-1,11-diazatetracyclo[7.4.1.02,7.010,12]tetradeca-2(7),3,5-trien-8-yl)methyl carbamate

Drug info:

PubChemData

Smile

CC1=C2COP(=O)(OC2=CC=C1)OCCOCN3C=NC4C3NC(NC4=O)N

DOS

IR

Vibrations