Geometry & MOs

Info

ID:	352085
PubChem CID:	127283153
Reduced:	OSN3C12H23 (1)
Stoich.:	ABC3D12E23 (1)
Weight, g/mol:	271.189592
ΔH_f, kcal/mol:	-62.46
Dipole, Da:	3.23
IP(EA), eV:	-8.75(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-hydroxyoxan-4-yl)methyl]-3-[(1-methylpyrrolidin-2-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1CN(CCS1)C(=O)NCC2CCCN2C

DOS

IR

Vibrations