Geometry & MOs

Info

ID:	234894
PubChem CID:	92303667
Reduced:	N2O5C24H26 (1)
Stoich.:	A2B5C24D26 (1)
Weight, g/mol:	418.225643
ΔH_f, kcal/mol:	-163.48
Dipole, Da:	6.57
IP(EA), eV:	-9.38(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(1,3-benzodioxol-4-yl)-N-cyclohexyl-3-(7-ethyl-1H-indol-3-yl)propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C(=O)N[C@H]1C2=CC=CC(=C2)C)C)COC3=CC=C(C=C3)C(=O)C

DOS

IR

Vibrations