Geometry & MOs

Info

ID:	185046
PubChem CID:	77246148
Reduced:	N3O4C22H29 (1)
Stoich.:	A3B4C22D29 (1)
Weight, g/mol:	786.315246
ΔH_f, kcal/mol:	-144.11
Dipole, Da:	5.95
IP(EA), eV:	-8.87(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis(7,9-dihydroxy-3-methyl-1,2,4,4a,7,7a,10,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl) naphthalene-2,7-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)CCNC(=O)C(C)(CC1=CC=C(C=C1)O)N(CC2=CC=NC=C2)C(=O)O

DOS

IR

Vibrations