Geometry & MOs

Info

ID:	393035
PubChem CID:	135019048
Reduced:	NO5C19H25 (1)
Stoich.:	AB5C19D25 (1)
Weight, g/mol:	326.118591
ΔH_f, kcal/mol:	-220.25
Dipole, Da:	0.76
IP(EA), eV:	-9.89(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N,N-diethyl-3-phenyl-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CC1(OC[C@H](O1)[C@H]2[C@@H](OC(O2)(C)C)C3=NC4=C(C=C3)C(=O)CCC4)C

DOS

IR

Vibrations