Geometry & MOs

Info

ID:	84126
PubChem CID:	49864329
Reduced:	ClFN4O4H22C25 (1)
Stoich.:	ABC4D4E22F25 (1)
Weight, g/mol:	389.12949
ΔH_f, kcal/mol:	-154.76
Dipole, Da:	4.64
IP(EA), eV:	-8.94(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[1-[(4-chlorophenyl)methyl]indol-3-yl]-N-pyridin-3-ylpropanamide

Drug info:

PubChemData

Smile

CC(=O)N1C[C@@H]([C@H](C1)C(=O)NC2=C(C=C(C=C2)N3C=CC=CC3=O)F)C(=O)NC4=CC=C(C=C4)Cl

DOS

IR

Vibrations