Geometry & MOs

Info

ID:	255762
PubChem CID:	103134596
Reduced:	NSO3C9H17 (1)
Stoich.:	ABC3D9E17 (1)
Weight, g/mol:	209.152812
ΔH_f, kcal/mol:	-149.75
Dipole, Da:	6.27
IP(EA), eV:	-9.24(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-(5-methyloxolan-3-yl)-1-(1-methylpyrazol-3-yl)methanamine

Drug info:

PubChemData

Smile

CC1CCC(O1)CSC[C@@H](C(=O)O)N

DOS

IR

Vibrations