Geometry & MOs

Info

ID:	354042
PubChem CID:	127285699
Reduced:	O3N5C17H27 (1)
Stoich.:	A3B5C17D27 (1)
Weight, g/mol:	311.220892
ΔH_f, kcal/mol:	-104.24
Dipole, Da:	2.76
IP(EA), eV:	-8.87(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-acetylpiperidin-4-yl)methyl]-3-(2-cyclopentyloxyethyl)urea

Drug info:

PubChemData

Smile

COC1=NC(=NC=C1)N2CCN(CC2)C(=O)NCCOC3CCCC3

DOS

IR

Vibrations