Geometry & MOs

Info

ID:	363607
PubChem CID:	127311686
Reduced:	ON3C9H15 (2)
Stoich.:	AB3C9D15 (2)
Weight, g/mol:	241.179027
ΔH_f, kcal/mol:	-55.21
Dipole, Da:	4.2
IP(EA), eV:	-8.68(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[cyclopropyl(methyl)amino]ethyl]-3-(oxan-4-yl)urea

Drug info:

PubChemData

Smile

COCC1CCN(CC1)C(=O)NCCN2CCN(CC2)C3=NC=CC=N3

DOS

IR

Vibrations