Geometry & MOs

Info

ID:	369341
PubChem CID:	127332369
Reduced:	N2O3C23H36 (1)
Stoich.:	A2B3C23D36 (1)
Weight, g/mol:	300.204907
ΔH_f, kcal/mol:	-146.73
Dipole, Da:	3.25
IP(EA), eV:	-9.48(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)NCC2(CCOCC2)C3=CC=CC=C3

DOS

IR

Vibrations