Geometry & MOs

Info

ID:	365910
PubChem CID:	127319175
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-99.82
Dipole, Da:	4.12
IP(EA), eV:	-9.07(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-dioxan-2-ylmethyl)-3-(1-phenylcyclopentyl)urea

Drug info:

PubChemData

Smile

CC(CN1CCCC1=O)NC(=O)NC2(CCCCC2)C3=CC=CC=C3

DOS

IR

Vibrations