Geometry & MOs

Info

ID:	360535
PubChem CID:	127301180
Reduced:	SO4N5C14H17 (1)
Stoich.:	AB4C5D14E17 (1)
Weight, g/mol:	385.12269
ΔH_f, kcal/mol:	-135.9
Dipole, Da:	4.71
IP(EA), eV:	-9.18(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chlorothiophen-2-yl)methyl]-3-[4-(oxolane-2-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)CN2CCC(=O)NC2=O)C(=O)NC3=NC=CS3

DOS

IR

Vibrations