Geometry & MOs

Info

ID:	128615
PubChem CID:	51052291
Reduced:	N2O3C12H12 (1)
Stoich.:	A2B3C12D12 (1)
Weight, g/mol:	302.163043
ΔH_f, kcal/mol:	-88.37
Dipole, Da:	10.15
IP(EA), eV:	-9.01(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2S)-4-methyl-2-[(1-methylindole-6-carbonyl)amino]pentanoate

Drug info:

PubChemData

Smile

CN1C=CC2=C(C=CC=C21)C(=O)NCC(=O)O

DOS

IR

Vibrations