Geometry & MOs

Info

ID:	227615
PubChem CID:	87562096
Reduced:	OC14H20 (1)
Stoich.:	AB14C20 (1)
Weight, g/mol:	485.187005
ΔH_f, kcal/mol:	-23.67
Dipole, Da:	3.35
IP(EA), eV:	-8.84(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-tert-butyl-1-[4-(6-chloro-3-phenyl-1,7-naphthyridin-2-yl)phenyl]cyclobutyl] carbamate

Drug info:

PubChemData

Smile

CC(=CC1CC(=CC=C1)C(C)(C)C)C=O

DOS

IR

Vibrations