Geometry & MOs

Info

ID:	255297
PubChem CID:	103131227
Reduced:	N3C16H29 (1)
Stoich.:	A3B16C29 (1)
Weight, g/mol:	211.114319
ΔH_f, kcal/mol:	4.62
Dipole, Da:	2.38
IP(EA), eV:	-8.75(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(1-methylpyrazol-3-yl)-1-(thiolan-2-yl)methanamine

Drug info:

PubChemData

Smile

CCCNC(C1CCCCCCC1)C2=NN(C=C2)C

DOS

IR

Vibrations