Geometry & MOs

Info

ID:	142799
PubChem CID:	53093327
Reduced:	O2N5C21H25 (1)
Stoich.:	A2B5C21D25 (1)
Weight, g/mol:	370.144806
ΔH_f, kcal/mol:	-19.54
Dipole, Da:	4.85
IP(EA), eV:	-8.42(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(4-chlorobenzoyl)-2,3-dihydroindol-5-yl]methyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCCN1C2=C(C=C(C=C2)C(=O)NC(C)C(=O)NC3=CC(=C(C=C3)C)C)N=N1

DOS

IR

Vibrations