Geometry & MOs

Info

ID:	138247
PubChem CID:	52333510
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	349.179027
ΔH_f, kcal/mol:	-41.22
Dipole, Da:	6.0
IP(EA), eV:	-9.36(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-benzyl-2-[[2-(3-methylindol-1-yl)acetyl]amino]propanamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NCC1=CC=CC=C1)NC(=O)CCCN2C=CC=N2

DOS

IR

Vibrations