Geometry & MOs

Info

ID:	369630
PubChem CID:	127334960
Reduced:	O2N3C19H31 (1)
Stoich.:	A2B3C19D31 (1)
Weight, g/mol:	353.123169
ΔH_f, kcal/mol:	-98.69
Dipole, Da:	4.69
IP(EA), eV:	-9.28(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-N-[(1-hydroxycycloheptyl)methyl]thieno[2,3-d][1,3]thiazole-5-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)NCC3(CCCCCC3)O

DOS

IR

Vibrations