Geometry & MOs

Info

ID:	354633
PubChem CID:	127287250
Reduced:	O2N5C17H29 (1)
Stoich.:	A2B5C17D29 (1)
Weight, g/mol:	337.193632
ΔH_f, kcal/mol:	-29.41
Dipole, Da:	2.94
IP(EA), eV:	-8.53(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(methyl)amino]propyl]-4-(1,3-thiazol-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)NCC(C)N(C)C3CC3

DOS

IR

Vibrations