Geometry & MOs

Info

ID:	198441
PubChem CID:	79101164
Reduced:	N2O3C14H24 (1)
Stoich.:	A2B3C14D24 (1)
Weight, g/mol:	232.168797
ΔH_f, kcal/mol:	-117.28
Dipole, Da:	5.03
IP(EA), eV:	-8.14(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-N-[(1-propan-2-ylpyrazol-3-yl)methyl]pyrrol-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(N1NCC(COCC2CCCO2)O)C

DOS

IR

Vibrations