Geometry & MOs

Info

ID:	335119
PubChem CID:	127253980
Reduced:	N2O5H24C25 (1)
Stoich.:	A2B5C24D25 (1)
Weight, g/mol:	323.199762
ΔH_f, kcal/mol:	-130.1
Dipole, Da:	6.27
IP(EA), eV:	-8.2(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(1H-indol-3-yl)ethyl]-6-pyrrol-1-ylhexanamide

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)C3=C(C4=CC=CC=C4C3=O)N(C2=O)CCC(=O)N5CCCC5)OC

DOS

IR

Vibrations