Geometry & MOs

Info

ID:	367396
PubChem CID:	127324428
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	362.177647
ΔH_f, kcal/mol:	-86.79
Dipole, Da:	5.54
IP(EA), eV:	-8.88(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-4-(5-methylthiophene-2-carbonyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCN(CC2)C(=O)NC3CCN(C3)C4CC4

DOS

IR

Vibrations