Geometry & MOs

Info

ID:	363931
PubChem CID:	127313588
Reduced:	SO2N3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	234.173213
ΔH_f, kcal/mol:	-74.25
Dipole, Da:	5.45
IP(EA), eV:	-9.23(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,3-dimethylpiperidin-1-yl)-(1,5-dimethylpyrrol-2-yl)methanone

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C(=O)C2=CN=C3N(C2=O)CCS3)C

DOS

IR

Vibrations