Geometry & MOs

Info

ID:	196551
PubChem CID:	78846801
Reduced:	N2F3O3C20H25 (1)
Stoich.:	A2B3C3D20E25 (1)
Weight, g/mol:	390.251858
ΔH_f, kcal/mol:	-261.98
Dipole, Da:	5.98
IP(EA), eV:	-9.71(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-[4-(4-hydroxyphenyl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC#CC1=CC(=CC=C1)C(F)(F)F)NC(=O)OC(C)(C)C

DOS

IR

Vibrations