Geometry & MOs

Info

ID:	369936
PubChem CID:	127336826
Reduced:	NO2C9H17 (2)
Stoich.:	AB2C9D17 (2)
Weight, g/mol:	364.283826
ΔH_f, kcal/mol:	-222.44
Dipole, Da:	4.55
IP(EA), eV:	-9.65(1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopentylpyrrolidin-3-yl)-3-[1-(oxolan-3-ylmethyl)piperidin-4-yl]urea

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)NCC(C2CCOCC2)O

DOS

IR

Vibrations