Geometry & MOs

Info

ID:	353966
PubChem CID:	127285606
Reduced:	O3N5C20H25 (1)
Stoich.:	A3B5C20D25 (1)
Weight, g/mol:	361.21139
ΔH_f, kcal/mol:	-99.6
Dipole, Da:	8.02
IP(EA), eV:	-9.41(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-acetylpiperidin-4-yl)methyl]-3-(6-morpholin-4-ylpyridin-3-yl)urea

Drug info:

PubChemData

Smile

CC1=NC(=O)C=C(N1)C2=CC=C(C=C2)NC(=O)NCC3CCN(CC3)C(=O)C

DOS

IR

Vibrations