Geometry & MOs

Info

ID:	266568
PubChem CID:	103571922
Reduced:	BrN4C14H19 (1)
Stoich.:	AB4C14D19 (1)
Weight, g/mol:	264.231397
ΔH_f, kcal/mol:	51.62
Dipole, Da:	4.35
IP(EA), eV:	-8.32(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-propan-2-ylpyrrolidin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)C(CN)NC2=CC=CC=C2Br

DOS

IR

Vibrations