Geometry & MOs

Info

ID:	214907
PubChem CID:	85083826
Reduced:	N7O11C27H39 (1)
Stoich.:	A7B11C27D39 (1)
Weight, g/mol:	637.267567
ΔH_f, kcal/mol:	-508.09
Dipole, Da:	12.25
IP(EA), eV:	-8.94(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-O-benzyl 2-O-methyl 4-[2,3-bis(phenylmethoxy)propyl]-7-(3-hydroxypropoxy)-1H-indole-2,5-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(CC(=O)N)C(=O)O)NC(=O)C(CC(=O)N)NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C(CC(=O)O)N

DOS

IR

Vibrations