Geometry & MOs

Info

ID:	353111
PubChem CID:	127284291
Reduced:	ON2C11H20 (2)
Stoich.:	AB2C11D20 (2)
Weight, g/mol:	395.166748
ΔH_f, kcal/mol:	-146.57
Dipole, Da:	4.14
IP(EA), eV:	-9.05(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-cyclopropylpiperazine-1-carbonyl)thiophen-2-yl]-2,3-dihydro-1H-indene-5-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1CCN(CC1)C(=O)NC2CCCCC2)N3CCCCC3

DOS

IR

Vibrations