Geometry & MOs

Info

ID:	365592
PubChem CID:	127318155
Reduced:	N2O3C13H24 (1)
Stoich.:	A2B3C13D24 (1)
Weight, g/mol:	382.240248
ΔH_f, kcal/mol:	-153.63
Dipole, Da:	3.77
IP(EA), eV:	-9.41(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(cyclohexylamino)-2-oxoethyl]-N-(thian-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NCC2(CCOC2)C

DOS

IR

Vibrations