Geometry & MOs

Info

ID:	367386
PubChem CID:	127324395
Reduced:	ON6C15H22 (1)
Stoich.:	AB6C15D22 (1)
Weight, g/mol:	263.17461
ΔH_f, kcal/mol:	28.69
Dipole, Da:	3.15
IP(EA), eV:	-9.2(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-(2-pyrazol-1-ylethyl)urea

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)NCCN3C=CC=N3

DOS

IR

Vibrations