Geometry & MOs

Info

ID:	343428
PubChem CID:	127266601
Reduced:	SN3O3C14H21 (1)
Stoich.:	AB3C3D14E21 (1)
Weight, g/mol:	316.178693
ΔH_f, kcal/mol:	-87.15
Dipole, Da:	4.04
IP(EA), eV:	-8.46(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[1-(1-anilinocyclopropanecarbonyl)piperidin-4-yl]acetate

Drug info:

PubChemData

Smile

CCS(=O)(=O)NCCNC(=O)C1(CC1)NC2=CC=CC=C2

DOS

IR

Vibrations