Geometry & MOs

Info

ID:	69279
PubChem CID:	46530570
Reduced:	O2N3C23H25 (1)
Stoich.:	A2B3C23D25 (1)
Weight, g/mol:	445.200156
ΔH_f, kcal/mol:	-28.33
Dipole, Da:	3.5
IP(EA), eV:	-8.72(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(oxolan-2-ylmethylcarbamoylamino)phenyl]-4-phenylmethoxybenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC=CC=C2)C)C(=O)NCC3=CC=C(C=C3)C(=O)N(C)C

DOS

IR

Vibrations