Geometry & MOs

Info

ID:	248552
PubChem CID:	103082556
Reduced:	O2N5C16H29 (1)
Stoich.:	A2B5C16D29 (1)
Weight, g/mol:	325.182398
ΔH_f, kcal/mol:	-77.82
Dipole, Da:	3.25
IP(EA), eV:	-9.26(0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-(1,3-thiazol-5-ylmethylamino)cycloheptyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCCCCC1NCC2=CN(N=N2)C

DOS

IR

Vibrations