Geometry & MOs

Info

ID:	371177
PubChem CID:	127344009
Reduced:	N3O3C17H25 (1)
Stoich.:	A3B3C17D25 (1)
Weight, g/mol:	345.241627
ΔH_f, kcal/mol:	-97.66
Dipole, Da:	2.96
IP(EA), eV:	-8.76(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclobutyl)methyl]-3-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]urea

Drug info:

PubChemData

Smile

CC(C)C1CN(CCN1C(=O)NCC2=C3C(=CC=C2)OCO3)C

DOS

IR

Vibrations