Geometry & MOs

Info

ID:	354561
PubChem CID:	127287175
Reduced:	O2N5C12H21 (1)
Stoich.:	A2B5C12D21 (1)
Weight, g/mol:	322.24811
ΔH_f, kcal/mol:	-62.77
Dipole, Da:	2.72
IP(EA), eV:	-8.88(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[(1-methylimidazol-2-yl)methyl]-1-[2-[methyl-(1-methylpiperidin-4-yl)amino]ethyl]urea

Drug info:

PubChemData

Smile

CN1CCOC(C1)CNC(=O)NCC2=NC=CN2C

DOS

IR

Vibrations