Geometry & MOs

Info

ID:	239074
PubChem CID:	93165950
Reduced:	SN2O4C25H30 (1)
Stoich.:	AB2C4D25E30 (1)
Weight, g/mol:	404.176979
ΔH_f, kcal/mol:	-93.55
Dipole, Da:	6.23
IP(EA), eV:	-8.98(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-N-[[2-[(2,6-dimethoxyphenoxy)methyl]-1,3-thiazol-4-yl]methyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC[C@H](C)N(CC1=CSC(=N1)COC2=C(C=CC=C2OC)OC)C(=O)C3=CC=C(C=C3)C

DOS

IR

Vibrations