Geometry & MOs

Info

ID:	62943
PubChem CID:	26737732
Reduced:	N2O5C20H24 (1)
Stoich.:	A2B5C20D24 (1)
Weight, g/mol:	366.140199
ΔH_f, kcal/mol:	-99.77
Dipole, Da:	7.51
IP(EA), eV:	-8.64(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(2S)-butan-2-yl]phenyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

CC[C@@H](C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2[N+](=O)[O-])OC)OCC

DOS

IR

Vibrations