Geometry & MOs

Info

ID:	32031
PubChem CID:	4253695
Reduced:	OSN5H23C25 (1)
Stoich.:	ABC5D23E25 (1)
Weight, g/mol:	300.204907
ΔH_f, kcal/mol:	104.96
Dipole, Da:	6.9
IP(EA), eV:	-8.68(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[(1-hydroxy-2-methylpropan-2-yl)carbamoyl]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=CC3=CC=CC=C32)C)C=C4C(=N)N5C(=NC4=O)SC(=N5)C(C)C

DOS

IR

Vibrations