Geometry & MOs

Info

ID:	368028
PubChem CID:	127326624
Reduced:	ON4C22H26 (1)
Stoich.:	AB4C22D26 (1)
Weight, g/mol:	379.200825
ΔH_f, kcal/mol:	-6.13
Dipole, Da:	3.22
IP(EA), eV:	-8.54(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(cyclopropanecarbonyl)piperidin-4-yl]-3-[4-(4-methylpyrimidin-2-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC1=NC(=NC=C1)C2=CC=C(C=C2)NC(=O)N3CC4CC5CC(C4)CC3C5

DOS

IR

Vibrations