Geometry & MOs

Info

ID:	371188
PubChem CID:	127344033
Reduced:	O2N4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	317.210327
ΔH_f, kcal/mol:	-47.17
Dipole, Da:	7.2
IP(EA), eV:	-9.02(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-hydroxycyclobutyl)methyl]-3-[1-(1-phenylethyl)pyrrolidin-3-yl]urea

Drug info:

PubChemData

Smile

CN1C(=CC=N1)C2CCN(CC2)C(=O)NCC3(CCCC3)C4=CC=CC=C4OC

DOS

IR

Vibrations