Geometry & MOs

Info

ID:	65216
PubChem CID:	29204626
Reduced:	ClN3O4C18H18 (1)
Stoich.:	AB3C4D18E18 (1)
Weight, g/mol:	448.15537
ΔH_f, kcal/mol:	-98.6
Dipole, Da:	4.7
IP(EA), eV:	-9.55(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(2R)-2-(4-ethoxy-3-methoxyphenyl)-2-(1H-indol-3-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NNC(=O)C2=CC=C(C=C2)Cl)C(=O)C3=CC=CO3

DOS

IR

Vibrations