Geometry & MOs

Info

ID:	397524
PubChem CID:	135030339
Reduced:	N3O3C19H25 (1)
Stoich.:	A3B3C19D25 (1)
Weight, g/mol:	357.168856
ΔH_f, kcal/mol:	-125.63
Dipole, Da:	3.81
IP(EA), eV:	-8.95(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-[(1R,12S)-2,16-dioxo-10-oxa-9,15-diazatetracyclo[7.7.0.01,12.03,8]hexadeca-3,5,7-trien-15-yl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)CN1CCC(C2=C(C1=O)C3=CC=CC=C3N2)CO

DOS

IR

Vibrations