Geometry & MOs

Info

ID:	351964
PubChem CID:	127282882
Reduced:	O2N5C20H31 (1)
Stoich.:	A2B5C20D31 (1)
Weight, g/mol:	350.268176
ΔH_f, kcal/mol:	-83.71
Dipole, Da:	3.9
IP(EA), eV:	-9.2(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(cyclopropylmethyl)piperidin-4-yl]-3-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]urea

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)CNC(=O)N2CCN(CC2)C(C)C(=O)NC3CCCC3

DOS

IR

Vibrations