Geometry & MOs

Info

ID:	198416
PubChem CID:	79098239
Reduced:	N3C14H19 (1)
Stoich.:	A3B14C19 (1)
Weight, g/mol:	272.200097
ΔH_f, kcal/mol:	48.67
Dipole, Da:	2.87
IP(EA), eV:	-8.62(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-[(3-cyclopropylimidazol-4-yl)methyl]pyrrol-3-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNC(C)C1=CN(C=C1)CC2=CC=NC=C2

DOS

IR

Vibrations