Geometry & MOs

Info

ID:	414726
PubChem CID:	135087687
Reduced:	NO2C16H29 (1)
Stoich.:	AB2C16D29 (1)
Weight, g/mol:	331.135448
ΔH_f, kcal/mol:	-135.39
Dipole, Da:	2.79
IP(EA), eV:	-8.43(2.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propyl-N-[(3R,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C3CCCCC3)O

DOS

IR

Vibrations