Geometry & MOs

Info

ID:	166013
PubChem CID:	74626424
Reduced:	N4O4C18H33 (1)
Stoich.:	A4B4C18D33 (1)
Weight, g/mol:	368.242356
ΔH_f, kcal/mol:	-191.08
Dipole, Da:	4.48
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.755066
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[[1-[2-(methylamino)-2-oxoethyl]piperidin-4-yl]carbamoyl]pyrrolidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCCC1C(=O)NC2CC[NH+](CC2)CC(=O)NC

DOS

IR

Vibrations