Geometry & MOs

Info

ID:	196938
PubChem CID:	78899482
Reduced:	ON7C22H23 (1)
Stoich.:	AB7C22D23 (1)
Weight, g/mol:	284.209993
ΔH_f, kcal/mol:	78.43
Dipole, Da:	11.42
IP(EA), eV:	-8.91(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[1-(oxolan-3-ylmethyl)piperidin-4-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)NC(=O)NC1=CC=C(C=C1)CNC2=CC(=NC3=NC=NN23)C4=CC=CC=C4

DOS

IR

Vibrations