Geometry & MOs

Info

ID:	52744
PubChem CID:	12015827
Reduced:	N4O4H26C27 (1)
Stoich.:	A4B4C26D27 (1)
Weight, g/mol:	413.210327
ΔH_f, kcal/mol:	-76.63
Dipole, Da:	5.21
IP(EA), eV:	-9.06(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(4-tert-butylbenzoyl)amino]phenyl]-2,3-dihydro-1H-indole-6-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)NC(=O)C3=CC4=C(C=C3)C=NN4

DOS

IR

Vibrations