Geometry & MOs

Info

ID:	280845
PubChem CID:	103851574
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	236.200097
ΔH_f, kcal/mol:	-38.0
Dipole, Da:	4.8
IP(EA), eV:	-9.35(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,5-dimethylpyrazol-4-yl)methyl]-1-propan-2-ylpyrrolidin-3-amine

Drug info:

PubChemData

Smile

COCC(=O)N1CCC(CC1)NCC2=CC=CC=C2C#N

DOS

IR

Vibrations