Geometry & MOs

Info

ID:	309413
PubChem CID:	126546088
Reduced:	N3C14H23 (1)
Stoich.:	A3B14C23 (1)
Weight, g/mol:	326.124212
ΔH_f, kcal/mol:	0.77
Dipole, Da:	3.36
IP(EA), eV:	-8.48(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5S)-2-oxatricyclo[3.3.1.13,7]decan-1-yl]-3-(2,3,4-trifluorophenyl)urea

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NC=C1)NC2CCNCC2

DOS

IR

Vibrations