Geometry & MOs

Info

ID:	335024
PubChem CID:	127253830
Reduced:	NO5H17C21 (1)
Stoich.:	AB5C17D21 (1)
Weight, g/mol:	435.252192
ΔH_f, kcal/mol:	-150.11
Dipole, Da:	5.72
IP(EA), eV:	-8.37(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,9R)-3,15-diazatetracyclo[7.7.1.02,7.010,15]heptadec-7-en-3-yl]-(4,7-dimethoxy-1H-indol-2-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C(O2)C3=CC4=C(C=C3)C=C(C=C4)OC)CC(=O)O)C(=O)N1

DOS

IR

Vibrations