Geometry & MOs

Info

ID:	367255
PubChem CID:	127324032
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	357.112316
ΔH_f, kcal/mol:	-94.27
Dipole, Da:	6.98
IP(EA), eV:	-9.46(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[2-[(3,5-dichloropyridin-2-yl)amino]ethyl]urea

Drug info:

PubChemData

Smile

C1CCC(CC1)CCNC(=O)N2CCNC(=O)CC2C3=CC=CC=C3

DOS

IR

Vibrations