Geometry & MOs

Info

ID:	191376
PubChem CID:	78139704
Reduced:	NO2C18H19 (2)
Stoich.:	AB2C18D19 (2)
Weight, g/mol:	576.298808
ΔH_f, kcal/mol:	-108.57
Dipole, Da:	2.67
IP(EA), eV:	-8.66(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)-4-naphthalen-1-ylbutyl]cyclopropyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CC1CC(CC2=CC3=CC=CC=C3C=C2)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

DOS

IR

Vibrations