Geometry & MOs

Info

ID:	431913
PubChem CID:	135172040
Reduced:	N3O5C27H31 (1)
Stoich.:	A3B5C27D31 (1)
Weight, g/mol:	429.189986
ΔH_f, kcal/mol:	-148.06
Dipole, Da:	7.72
IP(EA), eV:	-8.54(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[3-acetyl-6-acetyloxy-5-(cyclopropylcarbamoylamino)indol-1-yl]acetate

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C2=CC(=C(C=C21)NC(=O)NC3CC3)OCC4=CC=CC=C4)CC(=O)OC(C)(C)C

DOS

IR

Vibrations