Geometry & MOs

Info

ID:	264992
PubChem CID:	103506585
Reduced:	SN2O2C12H18 (1)
Stoich.:	AB2C2D12E18 (1)
Weight, g/mol:	310.135114
ΔH_f, kcal/mol:	-92.52
Dipole, Da:	6.51
IP(EA), eV:	-8.15(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-amino-5-(3-hydroxy-3-methylpiperidin-1-yl)-4-methoxythiophen-2-yl]-cyclopropylmethanone

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C(S1)N2CCCC(C2)(C)O)N

DOS

IR

Vibrations