Geometry & MOs

Info

ID:	322949
PubChem CID:	126671635
Reduced:	N3O6C29H39 (1)
Stoich.:	A3B6C29D39 (1)
Weight, g/mol:	422.187543
ΔH_f, kcal/mol:	-246.36
Dipole, Da:	6.51
IP(EA), eV:	-8.35(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[[2-[2-(3-hydroxypropoxy)ethoxy]-4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]carbamate

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCOCC(=O)OCC3=CC=CC=C3)NC(=O)OC(C)(C)C

DOS

IR

Vibrations